N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide

C12H16N4O3 — CID 83105085

IUPACN-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide
SMILESO=C(NC1CC1)C1COCCN1C(=O)n1ccnc1
InChIInChI=1S/C12H16N4O3/c17-11(14-9-1-2-9)10-7-19-6-5-16(10)12(18)15-4-3-13-8-15/h3-4,8-10H,1-2,5-7H2,(H,14,17)
InChIKeyMIGRFHFQMFRUEN-UHFFFAOYSA-N
MW264.28 g/mol
LogP-0.17
Rot. Bonds2

About N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide

N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide (PubChem CID 83105085) has the molecular formula C12H16N4O3 and a molecular weight of 264.28 g/mol. Its IUPAC name is N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide
PubChem CID83105085
Molecular FormulaC12H16N4O3
Molecular Weight264.28 g/mol
Exact Mass264.12
IUPAC NameN-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide
SMILESO=C(NC1CC1)C1COCCN1C(=O)n1ccnc1
InChIInChI=1S/C12H16N4O3/c17-11(14-9-1-2-9)10-7-19-6-5-16(10)12(18)15-4-3-13-8-15/h3-4,8-10H,1-2,5-7H2,(H,14,17)
InChIKeyMIGRFHFQMFRUEN-UHFFFAOYSA-N
XLogP-0.17
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-(imidazole-1-carbonyl)morpholine-3-carboxylate
CID 104775330
3-N-cyclopropyl-4-N-methylmorpholine-3,4-dicarboxamide
CID 116657472
N-cyclopropyl-4-(2,2-dimethylpropanoyl)morpholine-3-carboxamide
CID 83104501
N-cyclopropyl-4-(2-sulfanylacetyl)morpholine-3-carboxamide
CID 83105257
N-cyclopropyl-4-(2-hydrazinyl-2-oxoacetyl)morpholine-3-carboxamide
CID 83103627
4-[2-(3-aminopyrazol-1-yl)acetyl]-N-cyclopropylmorpholine-3-carboxamide
CID 83099535
N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide
CID 83097661
4-(2-bromo-3-methylbutanoyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83106807
4-(3-bromopyridine-2-carbonyl)-N-cyclopropylmorpholine-3-carboxamide
CID 107519258
N-cyclopropyl-4-(4-iodobenzoyl)morpholine-3-carboxamide
CID 83102563
4-(3-amino-1H-1,2,4-triazole-5-carbonyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83097063
4-(1-aminocyclopentanecarbonyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83098030

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide?
The IUPAC name of N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide (CID 83105085) is N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide is O=C(NC1CC1)C1COCCN1C(=O)n1ccnc1.
What is the InChIKey of N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide?
The InChIKey is MIGRFHFQMFRUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O3/c17-11(14-9-1-2-9)10-7-19-6-5-16(10)12(18)15-4-3-13-8-15/h3-4,8-10H,1-2,5-7H2,(H,14,17).
What are the key properties of N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide?
N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide has a molecular weight of 264.28 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(imidazole-1-carbonyl)morpholine-3-carboxamide is sourced from PubChem (CID 83105085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).